[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: [(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: [(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid [(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H24N4O3 MolecularWeight: 356.41886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OC(C)C(=O)NC2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)O[C@H](C)C(=O)NC2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C19H24N4O3/c1-13-17(22-23(21-13)16-11-7-4-8-12-16)19(25)26-14(2)18(24)20-15-9-5-3-6-10-15/h4,7-8,11-12,14-15H,3,5-6,9-10H2,1-2H3,(H,20,24)/t14-/m1/s1